SMILES:
COC(=O)CCC(C(N)=O)N1Cc2c(OCc3ccc(CN4CCC(OC)CC4)cc3)cccc2C1=OMolecular Processing
Molecular formula
C28H35N3O6
Molecular weight
509.6
Exact mass
509.2526
XLogP
2.64
TPSA
111.4
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
11
Heavy atoms
37
Rings
4
Aromatic rings
2
Saturated rings
1
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.464
Molar refractivity
136.63
Supplementary Information
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